| SpectraBase Spectrum ID |
3hotArOPXiZ |
| Name |
Ethyl 2-cyano-2-(4'-methyl-2'-(4-methylphenylsulfonamido)-3-phenyl-[4,5'-bithi-azol]-2(3H)-ylidene)acetate |
| Appearance |
Pale yellow crystals |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H22N4O4S3 |
| InChI |
InChI=1S/C25H22N4O4S3/c1-4-33-24(30)20(14-26)23-29(18-8-6-5-7-9-18)21(15-34-23)22-17(3)27-25(35-22)28-36(31,32)19-12-10-16(2)11-13-19/h5-13,15H,4H2,1-3H3,(H,27,28) |
| InChIKey |
XHFNFNGKYHZZFI-UHFFFAOYSA-N |
| Instrument Name |
VG Autospec |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jhet.3995 |
| Molecular Weight |
538.655 g/mol |
| SMILES |
N(S(c1ccc(cc1)C)(=O)=O)c1sc(c(n1)C)C=1N(C(SC1)=C(C(=O)OCC)C#N)c1ccccc1 |
| SPLASH |
splash10-001i-1901120000-417b78ea58af4d82bc81 |
| Source of Spectrum |
Y-57-2871-12 |
| Wiley ID |
1860244 |
![Ethyl 2-cyano-2-(4'-methyl-2'-(4-methylphenylsulfonamido)-3-phenyl-[4,5'-bithi-azol]-2(3H)-ylidene)acetate](/api/spectrum/3hotArOPXiZ/structure.png?h=300&w=458 "Ethyl 2-cyano-2-(4'-methyl-2'-(4-methylphenylsulfonamido)-3-phenyl-[4,5'-bithi-azol]-2(3H)-ylidene)acetate")
